2-[3-[3-chloranyl-5-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-phenoxy]propoxy]guanidine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-[3-[3-chloranyl-5-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-phenoxy]propoxy]guanidine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-[3-[3-chloro-5-[4-(2-pyridyl)piperazine-1-carbonyl]phenoxy]propoxy]guanidine; 2,2,2-trifluoroacetic acid CAS Name: 2-[3-[3-chloro-5-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]phenoxy]propoxy]guanidine; 2,2,2-trifluoroacetic acid IUPAC Name: 2-[3-[3-chloro-5-(4-pyridin-2-ylpiperazine-1-carbonyl)phenoxy]propoxy]guanidine; 2,2,2-trifluoroacetic acid Traditional Name: 2-[3-[3-chloro-5-[4-(2-pyridyl)piperazine-1-carbonyl]phenoxy]propoxy]guanidine; 2,2,2-trifluoroacetic acid Formula: C22H26ClF3N6O5 MolecularWeight: 546.92725

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC(=CC(=C3)Cl)OCCCON=C(N)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC(=CC(=C3)Cl)OCCCON=C(N)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H25ClN6O3.C2HF3O2/c21-16-12-15(13-17(14-16)29-10-3-11-30-25-20(22)23)19(28)27-8-6-26(7-9-27)18-4-1-2-5-24-18;3-2(4,5)1(6)7/h1-2,4-5,12-14H,3,6-11H2,(H4,22,23,25);(H,6,7)